- InChI
- InChI=1S/C6H12O/c1-2-3-4-5-6-7/h4-5,7H,2-3,6H2,1H3/b5-4+
- InChI Key
- ZCHHRLHTBGRGOT-SNAWJCMRSA-N
- Formula
- C6H12O
- SMILES
- CCCC=CCO
- Molecular Weight1
- 100.16
- CAS
- 928-95-0
- Other Names
-
- (E)-2-Hexen-1-ol
- (E)-2-Hexene-1-ol
- (E)-2-Hexenol
- (E)-Hex-2-enol
- 2-(E)-Hexenol
- 2-Hexen-1-ol, trans-
- 2-Hexenol
- E-Hex-2-en-1-ol
- Hex-2(E)-enol
- t-2-Hexen-1-ol
- trans-2-Hexen-1-Ol
- trans-2-Hexenol
- trans-hex-2-en-1-ol
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -56.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -202.18 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.59 | kJ/mol | Joback Calculated Property |
| log10WS | -1.45 | Crippen Calculated Property | |
| logPoct/wat | 1.335 | Crippen Calculated Property | |
| McVol | 96.970 | ml/mol | McGowan Calculated Property |
| Pc | 3673.09 | kPa | Joback Calculated Property |
| Inp | [824.00; 893.00] |
|
|
| Inp | 845.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 845.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 840.00 | NIST | |
| Inp | 849.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 854.00 | NIST | |
| Inp | Outlier 887.00 | NIST | |
| Inp | 854.00 | NIST | |
| Inp | 856.00 | NIST | |
| Inp | 863.00 | NIST | |
| Inp | Outlier 888.00 | NIST | |
| Inp | 856.00 | NIST | |
| Inp | 856.00 | NIST | |
| Inp | 851.00 | NIST | |
| Inp | Outlier 887.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | 848.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | Outlier 879.00 | NIST | |
| Inp | 861.00 | NIST | |
| Inp | 856.00 | NIST | |
| Inp | 845.00 | NIST | |
| Inp | 845.00 | NIST | |
| Inp | 846.00 | NIST | |
| Inp | 856.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | Outlier 833.00 | NIST | |
| Inp | Outlier 885.70 | NIST | |
| Inp | 861.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 861.00 | NIST | |
| Inp | 850.00 | NIST | |
| Inp | 851.00 | NIST | |
| Inp | 849.00 | NIST | |
| Inp | 850.00 | NIST | |
| Inp | 851.00 | NIST | |
| Inp | 860.00 | NIST | |
| Inp | 849.00 | NIST | |
| Inp | 855.00 | NIST | |
| Inp | 849.00 | NIST | |
| Inp | 850.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 855.00 | NIST | |
| Inp | 863.00 | NIST | |
| Inp | 847.00 | NIST | |
| Inp | 860.00 | NIST | |
| Inp | 845.00 | NIST | |
| Inp | 854.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 858.00 | NIST | |
| Inp | 845.00 | NIST | |
| Inp | 846.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 837.00 | NIST | |
| Inp | 858.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | Outlier 824.00 | NIST | |
| Inp | 849.00 | NIST | |
| Inp | 854.00 | NIST | |
| Inp | 857.00 | NIST | |
| Inp | 861.00 | NIST | |
| Inp | 854.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 852.00 | NIST | |
| Inp | 866.00 | NIST | |
| Inp | 845.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 861.00 | NIST | |
| Inp | 852.00 | NIST | |
| Inp | 863.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 841.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 845.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 852.00 | NIST | |
| Inp | 843.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 840.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | 845.00 | NIST | |
| Inp | 849.00 | NIST | |
| Inp | 850.00 | NIST | |
| Inp | 850.00 | NIST | |
| Inp | 858.00 | NIST | |
| Inp | 845.00 | NIST | |
| Inp | 857.00 | NIST | |
| Inp | 860.00 | NIST | |
| Inp | 858.00 | NIST | |
| Inp | 843.00 | NIST | |
| Inp | 844.00 | NIST | |
| Inp | 845.00 | NIST | |
| Inp | 846.00 | NIST | |
| Inp | 844.00 | NIST | |
| Inp | 844.00 | NIST | |
| Inp | 846.00 | NIST | |
| Inp | 845.00 | NIST | |
| Inp | 841.00 | NIST | |
| Inp | 854.00 | NIST | |
| Inp | 856.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 854.00 | NIST | |
| Inp | 849.00 | NIST | |
| Inp | 849.00 | NIST | |
| Inp | 852.00 | NIST | |
| Inp | 856.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 863.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | 849.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | 854.00 | NIST | |
| Inp | 848.00 | NIST | |
| Inp | 850.00 | NIST | |
| Inp | 844.00 | NIST | |
| Inp | 844.00 | NIST | |
| Inp | 850.00 | NIST | |
| Inp | Outlier 893.00 | NIST | |
| Inp | 856.00 | NIST | |
| Inp | 852.00 | NIST | |
| Inp | 862.00 | NIST | |
| Inp | 850.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 863.00 | NIST | |
| I | [1360.00; 1444.00] |
|
|
| I | Outlier 1363.00 | NIST | |
| I | 1419.00 | NIST | |
| I | 1401.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1411.00 | NIST | |
| I | 1409.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1388.00 | NIST | |
| I | 1420.00 | NIST | |
| I | 1411.00 | NIST | |
| I | 1409.00 | NIST | |
| I | 1380.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1409.00 | NIST | |
| I | 1380.00 | NIST | |
| I | 1394.00 | NIST | |
| I | 1403.00 | NIST | |
| I | 1394.00 | NIST | |
| I | 1392.00 | NIST | |
| I | 1407.00 | NIST | |
| I | 1406.00 | NIST | |
| I | 1406.00 | NIST | |
| I | 1414.00 | NIST | |
| I | 1391.00 | NIST | |
| I | 1414.00 | NIST | |
| I | Outlier 1444.00 | NIST | |
| I | 1421.70 | NIST | |
| I | 1406.00 | NIST | |
| I | 1408.00 | NIST | |
| I | 1408.00 | NIST | |
| I | 1390.00 | NIST | |
| I | 1406.00 | NIST | |
| I | 1400.00 | NIST | |
| I | 1402.00 | NIST | |
| I | 1388.00 | NIST | |
| I | 1407.00 | NIST | |
| I | 1411.00 | NIST | |
| I | 1377.00 | NIST | |
| I | 1419.00 | NIST | |
| I | 1387.00 | NIST | |
| I | 1390.00 | NIST | |
| I | 1390.00 | NIST | |
| I | 1389.00 | NIST | |
| I | 1387.00 | NIST | |
| I | 1390.00 | NIST | |
| I | 1390.00 | NIST | |
| I | 1397.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1407.00 | NIST | |
| I | 1390.00 | NIST | |
| I | 1390.00 | NIST | |
| I | 1390.00 | NIST | |
| I | 1417.00 | NIST | |
| I | 1402.00 | NIST | |
| I | 1409.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1373.00 | NIST | |
| I | 1379.00 | NIST | |
| I | 1406.00 | NIST | |
| I | 1406.00 | NIST | |
| I | Outlier 1360.00 | NIST | |
| I | Outlier 1360.00 | NIST | |
| I | 1420.00 | NIST | |
| I | 1401.00 | NIST | |
| I | 1370.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1416.00 | NIST | |
| I | 1408.00 | NIST | |
| I | 1413.00 | NIST | |
| I | 1370.00 | NIST | |
| I | 1417.00 | NIST | |
| I | 1370.00 | NIST | |
| I | 1400.00 | NIST | |
| I | Outlier 1432.00 | NIST | |
| I | 1417.00 | NIST | |
| I | 1414.00 | NIST | |
| I | 1403.00 | NIST | |
| I | 1417.00 | NIST | |
| I | 1408.00 | NIST | |
| I | 1403.00 | NIST | |
| I | 1400.00 | NIST | |
| I | Outlier 1433.00 | NIST | |
| I | 1412.00 | NIST | |
| I | 1390.00 | NIST | |
| I | 1411.00 | NIST | |
| I | 1408.00 | NIST | |
| I | 1407.00 | NIST | |
| I | 1392.00 | NIST | |
| I | 1392.00 | NIST | |
| I | 1393.00 | NIST | |
| I | 1405.00 | NIST | |
| I | Outlier 1363.00 | NIST | |
| I | 1398.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1386.00 | NIST | |
| I | 1380.00 | NIST | |
| I | 1381.00 | NIST | |
| I | 1418.10 | NIST | |
| I | 1404.00 | NIST | |
| I | 1401.00 | NIST | |
| I | 1404.00 | NIST | |
| I | 1427.00 | NIST | |
| I | 1380.00 | NIST | |
| I | 1383.00 | NIST | |
| I | 1380.00 | NIST | |
| I | 1383.00 | NIST | |
| I | 1408.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1380.00 | NIST | |
| I | 1383.00 | NIST | |
| I | 1380.00 | NIST | |
| I | 1383.00 | NIST | |
| I | Outlier 1361.00 | NIST | |
| I | 1380.00 | NIST | |
| I | 1380.00 | NIST | |
| I | 1408.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1409.00 | NIST | |
| I | 1407.00 | NIST | |
| I | 1414.00 | NIST | |
| I | 1413.00 | NIST | |
| I | 1402.00 | NIST | |
| I | 1390.00 | NIST | |
| I | 1429.00 | NIST | |
| I | 1412.00 | NIST | |
| I | 1413.00 | NIST | |
| I | 1388.00 | NIST | |
| I | 1414.00 | NIST | |
| I | 1411.00 | NIST | |
| I | 1412.00 | NIST | |
| I | 1415.00 | NIST | |
| I | 1368.00 | NIST | |
| I | 1415.00 | NIST | |
| I | 1406.00 | NIST | |
| I | 1408.00 | NIST | |
| I | 1375.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1404.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1410.00 | NIST | |
| I | 1368.00 | NIST | |
| I | 1380.00 | NIST | |
| I | 1383.00 | NIST | |
| I | 1383.00 | NIST | |
| I | 1404.00 | NIST | |
| Tboil | 432.20 | K | NIST |
| Tc | 601.76 | K | Joback Calculated Property |
| Tfus | 213.12 | K | Joback Calculated Property |
| Vc | 0.370 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [191.78; 240.99] | J/mol×K | [433.02; 601.76] |
|
| Cp,gas | 191.78 | J/mol×K | 433.02 | Joback Calculated Property |
| Cp,gas | 200.94 | J/mol×K | 461.14 | Joback Calculated Property |
| Cp,gas | 209.69 | J/mol×K | 489.27 | Joback Calculated Property |
| Cp,gas | 218.06 | J/mol×K | 517.39 | Joback Calculated Property |
| Cp,gas | 226.05 | J/mol×K | 545.51 | Joback Calculated Property |
| Cp,gas | 233.69 | J/mol×K | 573.64 | Joback Calculated Property |
| Cp,gas | 240.99 | J/mol×K | 601.76 | Joback Calculated Property |
| η | [0.0002006; 0.0918576] | Pa×s | [213.12; 433.02] |
|
| η | 0.0918576 | Pa×s | 213.12 | Joback Calculated Property |
| η | 0.0156415 | Pa×s | 249.77 | Joback Calculated Property |
| η | 0.0041899 | Pa×s | 286.42 | Joback Calculated Property |
| η | 0.0015133 | Pa×s | 323.07 | Joback Calculated Property |
| η | 0.0006726 | Pa×s | 359.72 | Joback Calculated Property |
| η | 0.0003473 | Pa×s | 396.37 | Joback Calculated Property |
| η | 0.0002006 | Pa×s | 433.02 | Joback Calculated Property |
| Pvap | [2.07e-04; 0.25] | kPa | [238.15; 308.15] |
|
| Pvap | 2.07e-04 | kPa | 238.15 | Vapor p... |
| Pvap | 2.10e-04 | kPa | 238.15 | Vapor p... |
| Pvap | 2.11e-04 | kPa | 238.15 | Vapor p... |
| Pvap | 4.04e-04 | kPa | 243.15 | Vapor p... |
| Pvap | 4.06e-04 | kPa | 243.15 | Vapor p... |
| Pvap | 4.07e-04 | kPa | 243.15 | Vapor p... |
| Pvap | 7.68e-04 | kPa | 248.15 | Vapor p... |
| Pvap | 7.72e-04 | kPa | 248.15 | Vapor p... |
| Pvap | 7.72e-04 | kPa | 248.15 | Vapor p... |
| Pvap | 1.40e-03 | kPa | 253.15 | Vapor p... |
| Pvap | 1.40e-03 | kPa | 253.15 | Vapor p... |
| Pvap | 1.40e-03 | kPa | 253.15 | Vapor p... |
| Pvap | 2.49e-03 | kPa | 258.15 | Vapor p... |
| Pvap | 2.49e-03 | kPa | 258.15 | Vapor p... |
| Pvap | 2.48e-03 | kPa | 258.15 | Vapor p... |
| Pvap | 4.31e-03 | kPa | 263.15 | Vapor p... |
| Pvap | 4.32e-03 | kPa | 263.15 | Vapor p... |
| Pvap | 4.32e-03 | kPa | 263.15 | Vapor p... |
| Pvap | 7.30e-03 | kPa | 268.15 | Vapor p... |
| Pvap | 7.31e-03 | kPa | 268.15 | Vapor p... |
| Pvap | 7.32e-03 | kPa | 268.15 | Vapor p... |
| Pvap | 0.01 | kPa | 273.15 | Vapor p... |
| Pvap | 0.01 | kPa | 273.15 | Vapor p... |
| Pvap | 0.01 | kPa | 273.15 | Vapor p... |
| Pvap | 0.01 | kPa | 273.65 | Vapor p... |
| Pvap | 0.01 | kPa | 273.65 | Vapor p... |
| Pvap | 0.01 | kPa | 273.65 | Vapor p... |
| Pvap | 0.02 | kPa | 278.15 | Vapor p... |
| Pvap | 0.02 | kPa | 278.15 | Vapor p... |
| Pvap | 0.02 | kPa | 278.15 | Vapor p... |
| Pvap | 0.03 | kPa | 283.15 | Vapor p... |
| Pvap | 0.03 | kPa | 283.15 | Vapor p... |
| Pvap | 0.03 | kPa | 283.15 | Vapor p... |
| Pvap | 0.05 | kPa | 288.15 | Vapor p... |
| Pvap | 0.05 | kPa | 288.15 | Vapor p... |
| Pvap | 0.05 | kPa | 288.15 | Vapor p... |
| Pvap | 0.08 | kPa | 293.15 | Vapor p... |
| Pvap | 0.08 | kPa | 293.15 | Vapor p... |
| Pvap | 0.08 | kPa | 293.15 | Vapor p... |
| Pvap | 0.11 | kPa | 298.15 | Vapor p... |
| Pvap | 0.11 | kPa | 298.15 | Vapor p... |
| Pvap | 0.11 | kPa | 298.15 | Vapor p... |
| Pvap | 0.17 | kPa | 303.15 | Vapor p... |
| Pvap | 0.17 | kPa | 303.15 | Vapor p... |
| Pvap | 0.17 | kPa | 303.15 | Vapor p... |
| Pvap | 0.25 | kPa | 308.15 | Vapor p... |
| Pvap | 0.25 | kPa | 308.15 | Vapor p... |
| Pvap | 0.25 | kPa | 308.15 | Vapor p... |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 375.20 | K | 13.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.22; 202.66] | kPa | [327.78; 456.48] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.59012e+01 | |||
| Coefficient B | -4.18494e+03 | |||
| Coefficient C | -6.12880e+01 | |||
| Temperature range, min. | 327.78 | |||
| Temperature range, max. | 456.48 | |||
| Pvap | 1.22 | kPa | 327.78 | Calculated Property |
| Pvap | 2.71 | kPa | 342.08 | Calculated Property |
| Pvap | 5.58 | kPa | 356.38 | Calculated Property |
| Pvap | 10.75 | kPa | 370.68 | Calculated Property |
| Pvap | 19.54 | kPa | 384.98 | Calculated Property |
| Pvap | 33.76 | kPa | 399.28 | Calculated Property |
| Pvap | 55.81 | kPa | 413.58 | Calculated Property |
| Pvap | 88.71 | kPa | 427.88 | Calculated Property |
| Pvap | 136.18 | kPa | 442.18 | Calculated Property |
| Pvap | 202.66 | kPa | 456.48 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Hexen-1-ol, (E)-.
Sources
- Crippen Method
- Crippen Method
- Vapor pressures and thermophysical properties of selected hexenols and recommended vapor pressure for hexan-1-ol
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
Take the time to validate and double check the source of the data.
Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.